SCHEMBL8327618

SCHEMBL8327618

COCc1nc(OCCO)c(Oc2cc(OC)ccc2Cl)c(N(CC(C)C)S(=O)(=O)c2ccccc2)n1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 7/20 0.42
EDNRB P24530 3/20 0.37
MAPT P10636 2/20 0.36
POLB P06746 1/20 0.36
DHPS P49366 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GAA P10253 1/20 0.34
NR1H2 P55055 1/20 0.34
MCL1 Q07820 2/20 0.34
BCL2L1 Q07817 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7322839 0.90 EDNRA (0.42) EDNRAEDNRBMAPTPOLBDHPS
SCHEMBL8325946 0.88 MAPT (0.38) MAPTPOLBMEN1KMT2AGAA
SCHEMBL8321015 0.87 EDNRA (0.45) EDNRAEDNRBMAPTPOLBMEN1
SCHEMBL7331086 0.84 EDNRA (0.36) EDNRAEDNRBMAPTPOLBMEN1
SCHEMBL7327693 0.84 EDNRA (0.37) EDNRAEDNRBPOLBMEN1KMT2A
SCHEMBL7327772 0.82 EDNRA (0.42) EDNRAEDNRBDHPSMEN1KMT2A
SCHEMBL7010894 0.80 MCL1 (0.38) EDNRAEDNRBMAPTPOLBMEN1
SCHEMBL7332509 0.80 RORC (0.38) MAPTPOLBMEN1KMT2AGAA
SCHEMBL7333240 0.80 EDNRA (0.50) EDNRAEDNRBDHPS
SCHEMBL8326182 0.79 EDNRB (0.45) EDNRAEDNRBMAPTPOLBMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0633259-B1 Sulfonylaminopyrimidines, their preparation and their use as medicine HOFFMANN LA ROCHE (CH) 1999-01-13 EP disclosed
EP-0633259-A1 Sulfonylaminopyrimidines, their preparation and their use as medicine F. HOFFMANN-LA ROCHE AG (CH) 1995-01-11 EP disclosed